1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-ethylquinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-ethylquinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-ethyl-2-quinolyl)sulfanyl]ethanone CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-ethyl-2-quinolinyl)thio]ethanone IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-ethylquinolin-2-yl)sulfanylethanone Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3-ethyl-2-quinolyl)thio]ethanone Formula: C21H19NO3S MolecularWeight: 365.44546

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=CC=CC=C2N=C1SCC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCC1=CC2=CC=CC=C2N=C1SCC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H19NO3S/c1-2-14-11-15-5-3-4-6-17(15)22-21(14)26-13-18(23)16-7-8-19-20(12-16)25-10-9-24-19/h3-8,11-12H,2,9-10,13H2,1H3